COMGENEX-ZINC06868948 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -0.6760 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -1.1620 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -1.4620 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -1.3040 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -0.8400 -1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -1.7130 -2.6620 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 -2.2620 -2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 -2.6740 -3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4630 -3.9850 -3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2380 -4.3710 -4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0420 -3.4510 -5.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0730 -2.1280 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2930 -1.7460 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9330 -1.1360 -5.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9580 0.0150 -5.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6880 -1.5090 -6.7030 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5400 -0.5270 -7.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2860 -1.2040 -8.5300 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.8970 -2.0210 -8.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1790 -0.1770 -9.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6760 -0.1990 -10.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9620 -1.5720 -10.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3450 -1.7080 -9.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -1.3300 2.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 -0.8940 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -1.9420 2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -0.4240 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 -3.1110 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -1.4470 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -4.7090 -3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2130 -5.3950 -5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6460 -3.7530 -6.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3150 -0.7240 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6680 -2.4280 -7.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2600 -0.1200 -6.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9220 0.2810 -7.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2250 -0.4800 -9.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0480 0.8150 -8.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5110 -0.1540 -11.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9740 0.6150 -10.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6850 -2.3720 -10.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2070 -1.5680 -11.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 0.1410 3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -1.5270 4.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -0.9730 3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 -3.0220 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 -1.5400 3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9240 -1.7210 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 M END